4-(3-phenyl-1-piperidin-1-yl-prop-2-ynyl)benzenecarbonitrile

Systemtic Name: 4-(3-phenyl-1-piperidin-1-yl-prop-2-ynyl)benzenecarbonitrile Openeye Name: 4-[3-phenyl-1-(1-piperidyl)prop-2-ynyl]benzonitrile CAS Name: 4-[3-phenyl-1-(1-piperidinyl)prop-2-ynyl]benzonitrile IUPAC Name: 4-(3-phenyl-1-piperidin-1-ylprop-2-ynyl)benzonitrile Traditional Name: 4-(3-phenyl-1-piperidino-prop-2-ynyl)benzonitrile Formula: C21H20N2 MolecularWeight: 300.3969

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(C#CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCN(CC1)C(C#CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H20N2/c22-17-19-9-12-20(13-10-19)21(23-15-5-2-6-16-23)14-11-18-7-3-1-4-8-18/h1,3-4,7-10,12-13,21H,2,5-6,15-16H2